A number of alkali and alkaline-earth nitrates crystallize in ionic structures related to the NaCl and fluorite crystal structures, respectively. This suggests that their cohesive properties may be usefully described by means of a phenomenological ionic model (Z. Akdeniz, M.P. Tosi, Zs. Naturforsch., 59a, 957 (2004)). In the present work we discuss from this viewpoint the structural transitions that take place in these materials. We first present a Bragg-Williams type approach to the orientational disordering of the NO3 groups and to positional melting in sodium nitrate. We then discuss the stability of the superionic CKN glass in terms of strongly bound Ca-2(NO3)(7) units surrounded by highly mobile potassium ions
We present a new rigid-ion force-field for the alkali metal nitrates that is suitable for simulating...
SIGLEAvailable from British Library Document Supply Centre- DSC:D061991 / BLDSC - British Library Do...
Sodium nitrate is isostructural with calcite and crystallizes in the space group DQd. It is one of t...
We propose and evaluate a structural model for mixed K-Ca nitrate melts and glasses, which invokes t...
We propose and evaluate a structural model for mixed K-Ca nitrate melts and glasses, which invokes t...
We evaluate the stability of various structures for a Ca-2(NO3)(7) core unit compensated by K or Rb ...
This PhD thesis is focused in structural aspects of alkali nitrates. In the first chapter, we recoll...
Divalent metal nitrates of barium, calcium, lead, and strontium are isomorphous, crystallizing in th...
Two models are proposed to solve the sodium nitrate structure near the order-disorder phase transiti...
Molecular dynamics computer simulations have been made of the ordered low-temperature and orientatio...
The Raman spectra have been studied of tertiary glasses formed by the progressive replacement of Ca(...
Several glasses of the nitrates of Mg2+, Cd2+ and Ca2+ with ammonium nitrate have been studied. The ...
High energy X-ray diffraction has been combined with containerless techniques to determine the struc...
Author Institution: Department of Chemistry, University of Queensland; Department of Chemistry, Okla...
Despite its large interesting as component for low melting HTF and HSM, very few thermodynamics info...
We present a new rigid-ion force-field for the alkali metal nitrates that is suitable for simulating...
SIGLEAvailable from British Library Document Supply Centre- DSC:D061991 / BLDSC - British Library Do...
Sodium nitrate is isostructural with calcite and crystallizes in the space group DQd. It is one of t...
We propose and evaluate a structural model for mixed K-Ca nitrate melts and glasses, which invokes t...
We propose and evaluate a structural model for mixed K-Ca nitrate melts and glasses, which invokes t...
We evaluate the stability of various structures for a Ca-2(NO3)(7) core unit compensated by K or Rb ...
This PhD thesis is focused in structural aspects of alkali nitrates. In the first chapter, we recoll...
Divalent metal nitrates of barium, calcium, lead, and strontium are isomorphous, crystallizing in th...
Two models are proposed to solve the sodium nitrate structure near the order-disorder phase transiti...
Molecular dynamics computer simulations have been made of the ordered low-temperature and orientatio...
The Raman spectra have been studied of tertiary glasses formed by the progressive replacement of Ca(...
Several glasses of the nitrates of Mg2+, Cd2+ and Ca2+ with ammonium nitrate have been studied. The ...
High energy X-ray diffraction has been combined with containerless techniques to determine the struc...
Author Institution: Department of Chemistry, University of Queensland; Department of Chemistry, Okla...
Despite its large interesting as component for low melting HTF and HSM, very few thermodynamics info...
We present a new rigid-ion force-field for the alkali metal nitrates that is suitable for simulating...
SIGLEAvailable from British Library Document Supply Centre- DSC:D061991 / BLDSC - British Library Do...
Sodium nitrate is isostructural with calcite and crystallizes in the space group DQd. It is one of t...